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(1E,4E)-1-(2-(Benzyloxy)-7-chloroquinolin-3-yl)-5-(4-hydroxy-3-methoxyphenyl)penta-1,4-dien-3-one
SpectraBase Compound ID HxKt2l0jStZ
InChI InChI=1S/C28H22ClNO4/c1-33-27-15-19(8-14-26(27)32)7-12-24(31)13-10-22-16-21-9-11-23(29)17-25(21)30-28(22)34-18-20-5-3-2-4-6-20/h2-17,32H,18H2,1H3/b12-7+,13-10+
InChIKey SVWBMIQTJJVUIL-IZENVRNYSA-N
Mol Weight 471.94 g/mol
Molecular Formula C28H22ClNO4
Exact Mass 471.123736 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KUck1yEa8w1
Name (1E,4E)-1-(2-(Benzyloxy)-7-chloroquinolin-3-yl)-5-(4-hydroxy-3-methoxyphenyl)penta-1,4-dien-3-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H22ClNO4
InChI InChI=1S/C28H22ClNO4/c1-33-27-15-19(8-14-26(27)32)7-12-24(31)13-10-22-16-21-9-11-23(29)17-25(21)30-28(22)34-18-20-5-3-2-4-6-20/h2-17,32H,18H2,1H3/b12-7+,13-10+
InChIKey SVWBMIQTJJVUIL-IZENVRNYSA-N
Instrument Name SHIMADZU GCMS 2010-DI-2010
Ionization Type EI
Literature Reference DOI 10.1002/ardp.202100094
Molecular Weight 471.940 g/mol
SMILES Oc1c(cc(cc1)\C=C\C(\C=C\c1cc2c(nc1OCc1ccccc1)cc(cc2)Cl)=O)OC
SPLASH splash10-0007-9521100000-fe4d52c4d673fab8615d
Source of Spectrum APC-354-17-17p
Wiley ID 1851444